(5E,7Z)-9-methoxynona-5,7-dien-1-amine

C10H19NO — CID 146590153

IUPAC(5E,7Z)-9-methoxynona-5,7-dien-1-amine
SMILESCOC/C=C\C=C\CCCCN
InChIInChI=1S/C10H19NO/c1-12-10-8-6-4-2-3-5-7-9-11/h2,4,6,8H,3,5,7,9-11H2,1H3/b4-2+,8-6-
InChIKeyQSLRRQAFFINQPB-VXZUYELYSA-N
MW169.27 g/mol
LogP1.87
Rot. Bonds7

About (5E,7Z)-9-methoxynona-5,7-dien-1-amine

(5E,7Z)-9-methoxynona-5,7-dien-1-amine (PubChem CID 146590153) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (5E,7Z)-9-methoxynona-5,7-dien-1-amine.

Molecular Properties

Compound Name(5E,7Z)-9-methoxynona-5,7-dien-1-amine
PubChem CID146590153
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(5E,7Z)-9-methoxynona-5,7-dien-1-amine
SMILESCOC/C=C\C=C\CCCCN
InChIInChI=1S/C10H19NO/c1-12-10-8-6-4-2-3-5-7-9-11/h2,4,6,8H,3,5,7,9-11H2,1H3/b4-2+,8-6-
InChIKeyQSLRRQAFFINQPB-VXZUYELYSA-N
XLogP1.87
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (5E,7Z)-9-methoxynona-5,7-dien-1-amine?
The IUPAC name of (5E,7Z)-9-methoxynona-5,7-dien-1-amine (CID 146590153) is (5E,7Z)-9-methoxynona-5,7-dien-1-amine.
What is the SMILES notation for (5E,7Z)-9-methoxynona-5,7-dien-1-amine?
The canonical SMILES for (5E,7Z)-9-methoxynona-5,7-dien-1-amine is COC/C=C\C=C\CCCCN.
What is the InChIKey of (5E,7Z)-9-methoxynona-5,7-dien-1-amine?
The InChIKey is QSLRRQAFFINQPB-VXZUYELYSA-N. The full InChI is InChI=1S/C10H19NO/c1-12-10-8-6-4-2-3-5-7-9-11/h2,4,6,8H,3,5,7,9-11H2,1H3/b4-2+,8-6-.
What are the key properties of (5E,7Z)-9-methoxynona-5,7-dien-1-amine?
(5E,7Z)-9-methoxynona-5,7-dien-1-amine has a molecular weight of 169.27 g/mol, XLogP of 1.87, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,7Z)-9-methoxynona-5,7-dien-1-amine is sourced from PubChem (CID 146590153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).